1-benzyl-3,7-dimethyl-8-[(2-phenylethyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Chemical Structure Depiction of
1-benzyl-3,7-dimethyl-8-[(2-phenylethyl)amino]-3,7-dihydro-1H-purine-2,6-dione
1-benzyl-3,7-dimethyl-8-[(2-phenylethyl)amino]-3,7-dihydro-1H-purine-2,6-dione
Compound characteristics
| Compound ID: | 7282-5801 |
| Compound Name: | 1-benzyl-3,7-dimethyl-8-[(2-phenylethyl)amino]-3,7-dihydro-1H-purine-2,6-dione |
| Molecular Weight: | 389.46 |
| Molecular Formula: | C22 H23 N5 O2 |
| Smiles: | CN1C(N(Cc2ccccc2)C(c2c1nc(NCCc1ccccc1)n2C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2792 |
| logD: | 3.2783 |
| logSw: | -3.4544 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 55.732 |
| InChI Key: | XWZYMCHAVSUEEH-UHFFFAOYSA-N |